4-isocyano-2-nitro-N-pentyl-aniline

Systemtic Name: 4-isocyano-2-nitro-N-pentyl-aniline Openeye Name: 4-isocyano-2-nitro-N-pentyl-aniline CAS Name: 4-isocyano-2-nitro-N-pentylaniline IUPAC Name: 4-isocyano-2-nitro-N-pentylaniline Traditional Name: amyl-(4-isocyano-2-nitro-phenyl)amine Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)[N+]#[C-])[N+](=O)[O-]

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)[N+]#[C-])[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O2/c1-3-4-5-8-14-11-7-6-10(13-2)9-12(11)15(16)17/h6-7,9,14H,3-5,8H2,1H3